| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2008 | 20 | Yes |
Popular Name: (1S)-1-(4-ethoxyphenyl)-2-(4-ethylpiperazin-1-yl)ethanamine (1S)-1-(4-ethoxyphenyl)-2-(4-eth…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.16 | 5.76 | -105.37 | 4 | 4 | 2 | 45 | 279.428 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.16 | 3.45 | -46.87 | 3 | 4 | 1 | 43 | 278.42 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.16 | 3.16 | -3.09 | 2 | 4 | 0 | 42 | 277.412 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.16 | 5.07 | -36.72 | 3 | 4 | 1 | 43 | 278.42 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.16 | 5.35 | -137.71 | 4 | 4 | 2 | 45 | 279.428 | 6 | ↓ |
